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(E)-2-[2-oxidanylidene-2-(3,3,5-trimethylcyclohexyl)oxy-ethyl]icos-4-enoic acid

(E)-2-[2-oxidanylidene-2-(3,3,5-trimethylcyclohexyl)oxy-ethyl]icos-4-enoic acid

Systemtic Name:(E)-2-[2-oxidanylidene-2-(3,3,5-trimethylcyclohexyl)oxy-ethyl]icos-4-enoic acid
Openeye Name:(E)-2-[2-oxo-2-(3,3,5-trimethylcyclohexoxy)ethyl]icos-4-enoic acid
CAS Name:(E)-2-[2-oxo-2-(3,3,5-trimethylcyclohexyl)oxyethyl]-4-eicosenoic acid
IUPAC Name:(E)-2-[2-oxo-2-(3,3,5-trimethylcyclohexyl)oxyethyl]icos-4-enoic acid
Traditional Name:(E)-2-[2-keto-2-(3,3,5-trimethylcyclohexoxy)ethyl]eicos-4-enoic acid
Formula: C31H56O4
MolecularWeight: 492.77394
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=CCC(CC(=O)OC1CC(CC(C1)(C)C)C)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/CC(CC(=O)OC1CC(CC(C1)(C)C)C)C(=O)O


InChI

InChI=1S/C31H56O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(30(33)34)23-29(32)35-28-22-26(2)24-31(3,4)25-28/h19-20,26-28H,5-18,21-25H2,1-4H3,(H,33,34)/b20-19+


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